SCHEMBL24379435

SCHEMBL24379435

COC(=O)c1cc(O)cc(F)c1C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.50
CA1 P00915 5/20 0.50
CA2 P00918 5/20 0.50
CA7 P43166 5/20 0.50
CA9 Q16790 5/20 0.50
CA14 Q9ULX7 5/20 0.50
CYP3A4 P08684 2/20 0.49
ACHE P22303 1/20 0.49
GAA P10253 4/20 0.48
POLB P06746 4/20 0.48
RECQL P46063 2/20 0.48
PDK2 Q15119 1/20 0.46
PDK4 Q16654 1/20 0.46
HPGD P15428 1/20 0.42
PTGS2 P35354 1/20 0.41
KDM4E B2RXH2 3/20 0.41
LMNA P02545 2/20 0.41
NFKB1 P19838 1/20 0.41
XDH P47989 1/20 0.41
GFER P55789 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL197844 0.88 CYP3A4 (0.55) CA12CA1CA2CA7CA9
SCHEMBL26741039 0.83 POLB (0.47) CA12CA1CA2CA7CA9
SCHEMBL24436888 0.83 CA12 (0.52) CA12CA1CA2CA7CA9
SCHEMBL27433790 0.81 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL18646092 0.80 CYP3A4 (0.47) CA12CA1CA2CA7CA9
SCHEMBL20076067 0.80 NOTUM (0.42) CA12CA1CA2CA7CA9
SCHEMBL24515988 0.80 CA12 (0.49) CA12CA1CA2CA7CA9
SCHEMBL159646 0.78 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL18105229 0.78 POLB (0.68) CA12CA1CA2CA7CA9
SCHEMBL29546667 0.78 POLB (0.68) CA12CA1CA2CA7CA9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022087125-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR PROTEIN ARVINAS OPERATIONS, INC. (US) 2022-04-28 WO disclosed